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DocumentationIdentifier: MM375792
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM375792 |
| SMILES |
COCC(OC)C(O)CO
|
| InChIKey |
WTUKZBHKAJYISL-UHFFFAOYSA-N
|
| MW [Da] |
150.17
Automatically obtained from RDkit software. |
| LogP |
-1
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM406506
Similarity: 0.8646
Similarity to MM406506
| Tanimoto metric | 0.8646 |
|---|---|
| Cosine metric | 0.9275 |
| Dice metric | 0.9274 |
| MW: | 150.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM400516
Similarity: 0.8387
Similarity to MM400516
| Tanimoto metric | 0.8387 |
|---|---|
| Cosine metric | 0.9142 |
| Dice metric | 0.9123 |
| MW: | 150.17 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -1 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM196835
Similarity: 0.7912
Similarity to MM196835
| Tanimoto metric | 0.7912 |
|---|---|
| Cosine metric | 0.8895 |
| Dice metric | 0.8834 |
| MW: | 136.15 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -1.65 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
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